A0A077ZGL6_TRITR Loading...

DNA directed RNA polymerase II subunit RPB9

AlphaFold DB , UniProt , Accession A0A077ZGL6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 122 aa.

						>A0A077ZGL6_TRITR|A0A077ZGL6
MQSNVSTPLSFVGIKFCPECNNMLYPRENKEERVLMYSCRNCDHRQVADNRCIYVNRVHEKSDDLSQINTDMVHDPTLPKTEEHPCPQCFQREAVFFQSQSTKAEVRSFSPSLTVSSCHRMC
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.1	Very low	45.3	Very low	246 Å²	246	133.4 Å²	133.4	100%	1.212	74%	0.742	S	S	*	*				0	94.2	0	-65.5	-171.9	170.5	0	0	108
2	Q	29.3	Very low	48.4	Very low	188 Å²	188	125.4 Å²	125.4	88%	0.879	70%	0.699	S	S	*	*			trans	-115.4	95.3	170.7	-81.6	164.4	17.8	0	0	106.2	N4	Q2-N4 PolarHBondContact O-N 3.06Å
3	S	31.4	Very low	51.2	Low	105 Å²	105	118.1 Å²	118.1	73%	0.734	67%	0.669	S	S	*	*			trans	-66.7	96.3	170.5	37.9	0	0	0	0	107.9	V5	S3-V5 PolarHBondContact O-N 2.85Å
4	N	30.9	Very low	54.1	Low	156 Å²	156	117.9 Å²	117.9	83%	0.834	66%	0.664	S	S	*	*			trans	-67.1	76.8	159.2	-86	-26.7	0	0	0	107.7	Q2 S6	Q2-N4 PolarHBondContact O-N 3.06Å; N4-S6 PolarHBondContact O-N 3.21Å
5	V	36.8	Very low	56.6	Low	111 Å²	111	113.7 Å²	113.7	67%	0.673	64%	0.635	S	S	*	*			trans	-68.6	93.5	160	179.6	0	0	0	0	104.7	S3 T7	S3-V5 PolarHBondContact O-N 2.85Å; V5-T7 PolarHBondContact O-N 3.12Å; V5-T7 PolarHBondContact O-OG1 3.15Å
6	S	36.4	Very low	59	Low	107 Å²	107	113.8 Å²	113.8	75%	0.748	63%	0.627	S	S	*	*			trans	-61	85.5	165.6	35.3	0	0	0	0	107.3	N4 P8	N4-S6 PolarHBondContact O-N 3.21Å; S6-P8 VanDerWaalsContact O-N 3.11Å
7	T	47.5	Very low	61.2	Low	104 Å²	104	107.2 Å²	107.2	64%	0.638	59%	0.591	S	S	*	*			trans	-52.2	121.5	168.3	-30.3	0	0	0	0	105.3	V5 L9	V5-T7 PolarHBondContact O-N 3.12Å; V5-T7 PolarHBondContact O-OG1 3.15Å; T7-L9 PolarHBondContact O-N 3.2Å
8	P	54.7	Low	63.1	Low	107 Å²	107	106.6 Å²	106.6	70%	0.695	59%	0.593	S	S	*	*			trans	-51.2	122.6	-177.2	19.6	-31	0	0	0	106.7	S6 S10	S6-P8 VanDerWaalsContact O-N 3.11Å; P8-S10 VanDerWaalsContact C-N 3.29Å; P8-S10 VanDerWaalsContact O-CA 3.28Å; P8-S10 WeakPolarHBondContact O-CA 3.22Å; P8-S10 PolarHBondContact O-N 3.08Å
9	L	58.2	Low	64.9	Low	108 Å²	108	108 Å²	108	57%	0.565	60%	0.595	S	S	*	*			trans	-39.8	98	-170.8	-79.3	163	0	0	0	108.6	T7 F11 V55 R57	T7-L9 PolarHBondContact O-N 3.2Å; L9-F11 PolarHBondContact O-N 2.68Å; L9-V55 HydrophobicContact CB-CG1 4.09Å; L9-V55 HydrophobicContact CB-CG2 4.21Å; L9-V55 HydrophobicContact CD1-CG1 4.09Å; L9-V55 HydrophobicContact CD2-CG2 4.32Å; L9-R57 PolarHBondContact O-NH2 3.36Å
10	S	63.7	Low	66.4	Low	59 Å²	59	105 Å²	105	41%	0.413	58%	0.581	S	S	.	*			trans	-64.8	140.6	-167.3	46.7	0	0	0	0	106.7	P8 V12 N50	P8-S10 VanDerWaalsContact C-N 3.29Å; P8-S10 VanDerWaalsContact O-CA 3.28Å; P8-S10 WeakPolarHBondContact O-CA 3.22Å; P8-S10 PolarHBondContact O-N 3.08Å; S10-V12 PolarHBondContact O-N 2.98Å; S10-N50 PolarHBondContact OG-ND2 2.83Å
11	F	70.6	Confident	67.8	Low	176 Å²	176	105.8 Å²	105.8	77%	0.772	58%	0.584	S	S	*	*			trans	-47.9	117.7	179.6	173.2	-102.6	0	0	0	109.3	L9 G13	L9-F11 PolarHBondContact O-N 2.68Å; F11-G13 VanDerWaalsContact C-N 3.33Å; F11-G13 VanDerWaalsContact CE1-CA 3.4Å; F11-G13 PolarHBondContact O-N 3.07Å
12	V	82	Confident	70.5	Confident	38 Å²	38	97.1 Å²	97.1	23%	0.23	54%	0.543	C	S	.	.			trans	-80.3	91.2	176.6	-177	0	0	0	0	106.6	S10 C52 I53 V55	S10-V12 PolarHBondContact O-N 2.98Å; V12-C52 WeakPolarHBondContact CG1-O 3.27Å; V12-C52 HydrophobicContact CG2-CB 4.05Å; V12-C52 WeakPolarHBondContact CG2-O 3.46Å; V12-I53 WeakPolarHBondContact CG1-O 3.41Å; V12-V55 HydrophobicContact CG2-CG2 3.76Å
13	G	85.7	Confident	73.7	Confident	30 Å²	30	91.9 Å²	91.9	31%	0.309	52%	0.52	S	S	.	.			trans	-71	149.3	-179	0	0	0	0	0	113	F11	F11-G13 VanDerWaalsContact C-N 3.33Å; F11-G13 VanDerWaalsContact CE1-CA 3.4Å; F11-G13 PolarHBondContact O-N 3.07Å
14	I	91.1	Very high	76.8	Confident	115 Å²	115	87.3 Å²	87.3	59%	0.59	49%	0.487	S	S	*	.			trans	-66.1	131.4	171.6	-58	170.6	0	0	0	108.3	F16 M23	I14-F16 HydrophobicContact CG2-CE1 4.35Å; I14-F16 HydrophobicContact CG2-CE2 4.07Å; I14-F16 HydrophobicContact CG2-CZ 3.89Å; I14-M23 HydrophobicContact CG2-CG 3.83Å; I14-M23 HydrophobicContact CG2-SD 3.9Å
15	K	92	Very high	79.8	Confident	55 Å²	55	83.5 Å²	83.5	24%	0.239	46%	0.461	C	S	.	.			trans	-105.5	141.2	175.7	-65.2	-166.6	174.3	-166.7	0	110.8	L24 Y37 D49	K15-L24 HydrophobicContact CB-CB 4.37Å; K15-L24 HydrophobicContact CB-CD1 4.12Å; K15-L24 PolarHBondContact O-N 3.31Å; K15-Y37 HydrophobicContact CD-CD2 3.92Å; K15-Y37 HydrophobicContact CD-CE2 3.81Å; K15-Y37 HydrophobicContact CD-CG 4.37Å; K15-D49 IonicContact NZ-OD2 3.8Å; K15-D49 PolarHBondContact NZ-OD2 3.2Å
16	F	95.4	Very high	82.6	Confident	116 Å²	116	81 Å²	81	51%	0.509	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-112.2	147.4	179.9	-66	-80.7	0	0	0	111.4	I14 L24	I14-F16 HydrophobicContact CG2-CE1 4.35Å; I14-F16 HydrophobicContact CG2-CE2 4.07Å; I14-F16 HydrophobicContact CG2-CZ 3.89Å; F16-L24 WeakPolarHBondContact O-CD1 3.37Å
17	C	96.4	Very high	85.4	Confident	2 Å²	2	82.6 Å²	82.6	1%	0.014	44%	0.437	C	S	.	.			trans	-70.5	129.5	176.4	177.5	0	0	0	0	110	E19 C20 N21 N22 L24 C39	C17-E19 PolarHBondContact O-N 3.39Å; C17-E19 PolarHBondContact SG-N 3.15Å; C17-C20 VanDerWaalsContact SG-SG 3.63Å; C17-N21 WeakPolarHBondContact O-CA 3.31Å; C17-N21 PolarHBondContact O-N 2.95Å; C17-N22 WeakPolarHBondContact CB-O 3.24Å; C17-N22 PolarHBondContact N-O 2.95Å; C17-L24 HydrophobicContact CB-CD2 3.76Å; C17-L24 HydrophobicContact CB-CG 4.24Å; C17-C39 HydrophobicContact CB-CB 4.23Å
18	P	95.5	Very high	87.6	Confident	96 Å²	96	83.6 Å²	83.6	62%	0.623	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-21.5	179.6	28.1	-34.5	0	0	0	113.5	H44	P18-H44 VanDerWaalsContact CD-NE2 3.32Å; P18-H44 WeakPolarHBondContact CD-NE2 3.28Å; P18-H44 VanDerWaalsContact CG-CE1 3.4Å; P18-H44 WeakPolarHBondContact CG-CE1 3.27Å
19	E	95.6	Very high	89.5	Confident	133 Å²	133	80.2 Å²	80.2	62%	0.621	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-45.7	-177.4	-59.4	-178.4	167.2	0	0	112.9	C17 C42	C17-E19 PolarHBondContact O-N 3.39Å; C17-E19 PolarHBondContact SG-N 3.15Å; E19-C42 PolarHBondContact OE2-SG 3.36Å
20	C	96.6	Very high	91.2	Very high	48 Å²	48	82.8 Å²	82.8	32%	0.324	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123	4.2	-171.9	66	0	0	0	0	114.4	C17 N22 C39	C17-C20 VanDerWaalsContact SG-SG 3.63Å; C20-N22 PolarHBondContact O-N 3.13Å; C20-C39 PolarHBondContact SG-SG 2.07Å
21	N	95.5	Very high	92.7	Very high	121 Å²	121	88.6 Å²	88.6	65%	0.647	44%	0.438	S	S	*	.			trans	54.5	21.3	179.6	-157.3	31.6	0	0	0	115.2	C17	C17-N21 WeakPolarHBondContact O-CA 3.31Å; C17-N21 PolarHBondContact O-N 2.95Å
22	N	96.1	Very high	93.8	Very high	65 Å²	65	86.6 Å²	86.6	35%	0.348	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-84.7	155.6	172.5	-78.4	-52.9	0	0	0	111.4	C17 C20 L24 N41	C17-N22 WeakPolarHBondContact CB-O 3.24Å; C17-N22 PolarHBondContact N-O 2.95Å; C20-N22 PolarHBondContact O-N 3.13Å; N22-L24 PolarHBondContact O-N 2.66Å; N22-N41 PolarHBondContact ND2-OD1 2.85Å
23	M	95.2	Very high	94.4	Very high	78 Å²	78	95.1 Å²	95.1	38%	0.384	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-61.1	131.2	177.5	-171.9	169.7	71.7	0	0	111.2	I14 Y25	I14-M23 HydrophobicContact CG2-CG 3.83Å; I14-M23 HydrophobicContact CG2-SD 3.9Å; M23-Y25 HydrophobicContact CE-CD1 4.37Å; M23-Y25 HydrophobicContact CE-CE1 3.46Å; M23-Y25 VanDerWaalsContact CE-CE1 3.46Å; M23-Y25 HydrophobicContact CE-CE2 4.23Å; M23-Y25 VanDerWaalsContact CE-OH 3.23Å; M23-Y25 WeakPolarHBondContact CE-OH 3.34Å; M23-Y25 WeakPolarHBondContact O-CD2 3.24Å; M23-Y25 WeakPolarHBondContact O-CE2 3.39Å
24	L	96.2	Very high	94.8	Very high	8 Å²	8	96 Å²	96	4%	0.042	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-84.9	140.6	174.6	-66.8	174	0	0	0	111.1	K15 F16 C17 N22 Y37 C39 Q46	K15-L24 HydrophobicContact CB-CB 4.37Å; K15-L24 HydrophobicContact CB-CD1 4.12Å; K15-L24 PolarHBondContact O-N 3.31Å; F16-L24 WeakPolarHBondContact O-CD1 3.37Å; C17-L24 HydrophobicContact CB-CD2 3.76Å; C17-L24 HydrophobicContact CB-CG 4.24Å; N22-L24 PolarHBondContact O-N 2.66Å; L24-Y37 HydrophobicContact CB-CD1 4.21Å; L24-Y37 HydrophobicContact CB-CG 4.49Å; L24-C39 HydrophobicContact CD2-CB 3.86Å; L24-Q46 HydrophobicContact CD1-CG 4.35Å
25	Y	95.4	Very high	94.9	Very high	77 Å²	77	92.4 Å²	92.4	30%	0.302	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.9	-179.5	-66.2	-91.3	0	0	0	111.6	M23 Y37 S38 R40	M23-Y25 HydrophobicContact CE-CD1 4.37Å; M23-Y25 HydrophobicContact CE-CE1 3.46Å; M23-Y25 VanDerWaalsContact CE-CE1 3.46Å; M23-Y25 HydrophobicContact CE-CE2 4.23Å; M23-Y25 VanDerWaalsContact CE-OH 3.23Å; M23-Y25 WeakPolarHBondContact CE-OH 3.34Å; M23-Y25 WeakPolarHBondContact O-CD2 3.24Å; M23-Y25 WeakPolarHBondContact O-CE2 3.39Å; Y25-Y37 CarbonylContact O-C 3.57Å; Y25-Y37 WeakPolarHBondContact O-CA 3.48Å; Y25-S38 PolarHBondContact N-O 3.04Å; Y25-S38 PolarHBondContact O-N 3.24Å; Y25-S38 PolarHBondContact O-OG 3.43Å; Y25-R40 HydrophobicContact CD2-CG 3.72Å; Y25-R40 HydrophobicContact CE2-CG 3.84Å
26	P	94.5	Very high	95.1	Very high	59 Å²	59	91.3 Å²	91.3	38%	0.383	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	134.5	174.4	28.6	-35.8	0	0	0	110.7	L35 M36 Y37 I53	P26-L35 HydrophobicContact CB-CD1 4.03Å; P26-M36 CarbonylContact C-O 3.49Å; P26-M36 WeakPolarHBondContact CA-O 3.49Å; P26-Y37 HydrophobicContact CB-CE1 4.48Å; P26-I53 HydrophobicContact CB-CD1 4.21Å; P26-I53 HydrophobicContact CB-CG2 3.62Å; P26-I53 HydrophobicContact CG-CG2 3.47Å; P26-I53 VanDerWaalsContact CG-CG2 3.47Å
27	R	94.5	Very high	95.1	Very high	139 Å²	139	86.6 Å²	86.6	53%	0.525	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	137.7	179.9	-171.1	177.2	-177.4	168.2	1.7	109.6	M36 S38	R27-M36 PolarHBondContact N-O 3.33Å; R27-M36 WeakPolarHBondContact O-CA 3.23Å; R27-M36 WeakPolarHBondContact O-CB 3.38Å; R27-M36 PolarHBondContact O-N 2.8Å; R27-M36 VanDerWaalsContact O-O 3.08Å; R27-S38 WeakPolarHBondContact CD-OG 3.43Å
28	E	95.3	Very high	95.1	Very high	126 Å²	126	87 Å²	87	59%	0.589	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	132.4	175.4	-176.1	-174.1	-168	0	0	110.8	K30	E28-K30 HydrophobicContact CG-CG 4.28Å
29	N	93.7	Very high	95.1	Very high	36 Å²	36	83.1 Å²	83.1	19%	0.193	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	106.2	158.6	-177.1	-2.1	0	0	0	108.7	E31 E32 R33 V34 M36	N29-E31 VanDerWaalsContact C-N 3.34Å; N29-E31 PolarHBondContact O-N 2.98Å; N29-E31 PolarHBondContact OD1-N 3.12Å; N29-E32 PolarHBondContact ND2-OE2 3.13Å; N29-E32 VanDerWaalsContact ND2-OE2 3.07Å; N29-R33 WeakPolarHBondContact O-CA 3.46Å; N29-R33 PolarHBondContact O-N 3.29Å; N29-V34 HydrophobicContact CB-CG2 3.79Å; N29-V34 PolarHBondContact N-O 3.4Å; N29-V34 PolarHBondContact O-N 3.29Å; N29-M36 HydrophobicContact CB-CG 4.31Å; N29-M36 HydrophobicContact CB-SD 3.66Å
30	K	94	Very high	95.1	Very high	162 Å²	162	85.5 Å²	85.5	70%	0.704	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-29.6	-172.3	-65.4	-176.6	178.7	-176.4	0	113.8	E28	E28-K30 HydrophobicContact CG-CG 4.28Å
31	E	95.4	Very high	95.1	Very high	181 Å²	181	88.9 Å²	88.9	85%	0.846	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-48.7	-176.8	-67.6	165.4	-165.5	0	0	110.2	N29	N29-E31 VanDerWaalsContact C-N 3.34Å; N29-E31 PolarHBondContact O-N 2.98Å; N29-E31 PolarHBondContact OD1-N 3.12Å
32	E	94.3	Very high	95.1	Very high	133 Å²	133	84.7 Å²	84.7	62%	0.621	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.7	-179.9	-65.4	-179.2	159.2	0	0	113.2	N29 V34	N29-E32 PolarHBondContact ND2-OE2 3.13Å; N29-E32 VanDerWaalsContact ND2-OE2 3.07Å; E32-V34 VanDerWaalsContact C-N 3.27Å; E32-V34 HydrophobicContact CB-CG1 4.21Å; E32-V34 HydrophobicContact CB-CG2 3.89Å; E32-V34 PolarHBondContact O-N 3.36Å
33	R	93.2	Very high	95.1	Very high	218 Å²	218	88.4 Å²	88.4	82%	0.823	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	41.1	-174.7	-57	178.6	178.5	176.4	-0.6	112.8	N29	N29-R33 WeakPolarHBondContact O-CA 3.46Å; N29-R33 PolarHBondContact O-N 3.29Å
34	V	94.6	Very high	95.1	Very high	48 Å²	48	86.2 Å²	86.2	29%	0.291	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	144	178.7	-62.9	0	0	0	0	111.7	N29 E32 M36	N29-V34 HydrophobicContact CB-CG2 3.79Å; N29-V34 PolarHBondContact N-O 3.4Å; N29-V34 PolarHBondContact O-N 3.29Å; E32-V34 VanDerWaalsContact C-N 3.27Å; E32-V34 HydrophobicContact CB-CG1 4.21Å; E32-V34 HydrophobicContact CB-CG2 3.89Å; E32-V34 PolarHBondContact O-N 3.36Å; V34-M36 HydrophobicContact CG2-CG 4.12Å; V34-M36 HydrophobicContact CG2-SD 4.41Å
35	L	94.1	Very high	95.1	Very high	39 Å²	39	92.4 Å²	92.4	20%	0.204	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.9	169.4	177.9	66.3	0	0	0	109.1	P26 A48 I53	P26-L35 HydrophobicContact CB-CD1 4.03Å; L35-A48 HydrophobicContact CB-CB 4.01Å; L35-A48 HydrophobicContact CD2-CB 3.69Å; L35-A48 HydrophobicContact CG-CB 3.63Å; L35-A48 VanDerWaalsContact O-CB 3.31Å; L35-A48 WeakPolarHBondContact O-CB 3.36Å; L35-A48 PolarHBondContact O-N 2.88Å; L35-I53 HydrophobicContact CD1-CD1 3.84Å; L35-I53 HydrophobicContact CD1-CG1 4.48Å; L35-I53 HydrophobicContact CD2-CD1 4.08Å; L35-I53 HydrophobicContact CD2-CG1 3.85Å
36	M	95	Very high	95	Very high	33 Å²	33	91.4 Å²	91.4	16%	0.163	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	158.3	177	-64.1	-175.6	61.2	0	0	110.9	P26 R27 N29 V34 R45 Q46	P26-M36 CarbonylContact C-O 3.49Å; P26-M36 WeakPolarHBondContact CA-O 3.49Å; R27-M36 PolarHBondContact N-O 3.33Å; R27-M36 WeakPolarHBondContact O-CA 3.23Å; R27-M36 WeakPolarHBondContact O-CB 3.38Å; R27-M36 PolarHBondContact O-N 2.8Å; R27-M36 VanDerWaalsContact O-O 3.08Å; N29-M36 HydrophobicContact CB-CG 4.31Å; N29-M36 HydrophobicContact CB-SD 3.66Å; V34-M36 HydrophobicContact CG2-CG 4.12Å; V34-M36 HydrophobicContact CG2-SD 4.41Å; M36-R45 HydrophobicContact CE-CB 3.68Å; M36-Q46 CarbonylContact C-O 3.58Å; M36-Q46 VanDerWaalsContact CA-O 3.24Å; M36-Q46 WeakPolarHBondContact CA-O 3.3Å; M36-Q46 WeakPolarHBondContact CB-O 3.45Å
37	Y	95.8	Very high	95	Very high	16 Å²	16	92.8 Å²	92.8	6%	0.063	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.3	166.5	-76.4	-76.2	0	0	0	108.6	K15 L24 Y25 P26 R45 Q46 A48	K15-Y37 HydrophobicContact CD-CD2 3.92Å; K15-Y37 HydrophobicContact CD-CE2 3.81Å; K15-Y37 HydrophobicContact CD-CG 4.37Å; L24-Y37 HydrophobicContact CB-CD1 4.21Å; L24-Y37 HydrophobicContact CB-CG 4.49Å; Y25-Y37 CarbonylContact O-C 3.57Å; Y25-Y37 WeakPolarHBondContact O-CA 3.48Å; P26-Y37 HydrophobicContact CB-CE1 4.48Å; Y37-R45 CarbonylContact O-C 3.47Å; Y37-R45 VanDerWaalsContact O-CA 3.31Å; Y37-R45 WeakPolarHBondContact O-CA 3.21Å; Y37-Q46 PolarHBondContact N-O 3.4Å; Y37-Q46 PolarHBondContact O-N 2.83Å; Y37-A48 HydrophobicContact CD2-CB 3.73Å; Y37-A48 HydrophobicContact CE2-CB 3.5Å
38	S	95.8	Very high	94.9	Very high	12 Å²	12	87 Å²	87	8%	0.084	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.2	-178.7	59.6	0	0	0	0	111.6	Y25 R27	Y25-S38 PolarHBondContact N-O 3.04Å; Y25-S38 PolarHBondContact O-N 3.24Å; Y25-S38 PolarHBondContact O-OG 3.43Å; R27-S38 WeakPolarHBondContact CD-OG 3.43Å
39	C	97.1	Very high	94.7	Very high	13 Å²	13	87.5 Å²	87.5	9%	0.088	42%	0.416	C	S	.	.			trans	-78.6	152.2	171.7	-165.9	0	0	0	0	110.6	C17 C20 L24 N41 H44	C17-C39 HydrophobicContact CB-CB 4.23Å; C20-C39 PolarHBondContact SG-SG 2.07Å; L24-C39 HydrophobicContact CD2-CB 3.86Å; C39-N41 PolarHBondContact SG-N 2.88Å; C39-N41 VanDerWaalsContact SG-N 3.43Å; C39-H44 HydrophobicContact CB-CB 4.41Å; C39-H44 PolarHBondContact N-O 2.98Å
40	R	95.7	Very high	94.4	Very high	183 Å²	183	88.6 Å²	88.6	69%	0.691	42%	0.422	S	S	*	.	S	Bend	trans	-91.2	-21.4	172.3	-69.6	-176.6	180	-167.4	-1.2	113.2	Y25	Y25-R40 HydrophobicContact CD2-CG 3.72Å; Y25-R40 HydrophobicContact CE2-CG 3.84Å
41	N	95.4	Very high	94.2	Very high	119 Å²	119	91.1 Å²	91.1	64%	0.636	43%	0.427	S	S	*	.	S	Bend	trans	-99.6	-21.9	-172.3	-65.8	79.3	0	0	0	113.2	N22 C39	N22-N41 PolarHBondContact ND2-OD1 2.85Å; C39-N41 PolarHBondContact SG-N 2.88Å; C39-N41 VanDerWaalsContact SG-N 3.43Å
42	C	96.2	Very high	93.9	Very high	33 Å²	33	84 Å²	84	22%	0.223	40%	0.397	C	S	.	.	S	Bend	trans	-138.5	177.5	174.6	72.4	0	0	0	0	110.7	E19 H44	E19-C42 PolarHBondContact OE2-SG 3.36Å; C42-H44 VanDerWaalsContact C-N 3.26Å; C42-H44 PolarHBondContact O-N 3.18Å; C42-H44 VanDerWaalsContact SG-CB 3.53Å
43	D	95.7	Very high	93.7	Very high	143 Å²	143	81.8 Å²	81.8	77%	0.765	39%	0.388	S	S	*	.	S	Bend	trans	-83.4	5.5	-178.2	-72.6	-47.1	0	0	0	114.5	R45	D43-R45 PolarHBondContact O-N 3.43Å
44	H	96.3	Very high	93.6	Very high	33 Å²	33	79.7 Å²	79.7	15%	0.153	38%	0.382	C	S	.	.			trans	-60.1	131.4	178.4	-177.2	75.9	0	0	0	112.2	P18 C39 C42 Q46	P18-H44 VanDerWaalsContact CD-NE2 3.32Å; P18-H44 WeakPolarHBondContact CD-NE2 3.28Å; P18-H44 VanDerWaalsContact CG-CE1 3.4Å; P18-H44 WeakPolarHBondContact CG-CE1 3.27Å; C39-H44 HydrophobicContact CB-CB 4.41Å; C39-H44 PolarHBondContact N-O 2.98Å; C42-H44 VanDerWaalsContact C-N 3.26Å; C42-H44 PolarHBondContact O-N 3.18Å; C42-H44 VanDerWaalsContact SG-CB 3.53Å; H44-Q46 PolarHBondContact NE2-OE1 2.65Å
45	R	94.8	Very high	93.3	Very high	137 Å²	137	79.2 Å²	79.2	52%	0.517	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	145.7	177.2	-60	177.5	-166.7	172	6.9	110.1	M36 Y37 D43	M36-R45 HydrophobicContact CE-CB 3.68Å; Y37-R45 CarbonylContact O-C 3.47Å; Y37-R45 VanDerWaalsContact O-CA 3.31Å; Y37-R45 WeakPolarHBondContact O-CA 3.21Å; D43-R45 PolarHBondContact O-N 3.43Å
46	Q	94.4	Very high	92.9	Very high	57 Å²	57	82.4 Å²	82.4	27%	0.266	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	152	177.7	63.8	-174.4	71.9	0	0	111.4	L24 M36 Y37 H44	L24-Q46 HydrophobicContact CD1-CG 4.35Å; M36-Q46 CarbonylContact C-O 3.58Å; M36-Q46 VanDerWaalsContact CA-O 3.24Å; M36-Q46 WeakPolarHBondContact CA-O 3.3Å; M36-Q46 WeakPolarHBondContact CB-O 3.45Å; Y37-Q46 PolarHBondContact N-O 3.4Å; Y37-Q46 PolarHBondContact O-N 2.83Å; H44-Q46 PolarHBondContact NE2-OE1 2.65Å
47	V	93.9	Very high	92.3	Very high	88 Å²	88	86.2 Å²	86.2	53%	0.533	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	144.4	176.2	-177.9	0	0	0	0	110
48	A	92.6	Very high	91.6	Very high	17 Å²	17	90.7 Å²	90.7	14%	0.14	44%	0.437	C	S	.	.			trans	-84	126.8	178	0	0	0	0	0	111.9	L35 Y37 N50	L35-A48 HydrophobicContact CB-CB 4.01Å; L35-A48 HydrophobicContact CD2-CB 3.69Å; L35-A48 HydrophobicContact CG-CB 3.63Å; L35-A48 VanDerWaalsContact O-CB 3.31Å; L35-A48 WeakPolarHBondContact O-CB 3.36Å; L35-A48 PolarHBondContact O-N 2.88Å; Y37-A48 HydrophobicContact CD2-CB 3.73Å; Y37-A48 HydrophobicContact CE2-CB 3.5Å; A48-N50 VanDerWaalsContact C-N 3.35Å
49	D	90.4	Very high	90.6	Very high	136 Å²	136	98.7 Å²	98.7	73%	0.727	47%	0.473	S	S	*	.	S	Bend	trans	-70.9	-32.5	176	-40.6	-61.5	0	0	0	112.3	K15	K15-D49 IonicContact NZ-OD2 3.8Å; K15-D49 PolarHBondContact NZ-OD2 3.2Å
50	N	88.5	Confident	89.2	Confident	60 Å²	60	103.7 Å²	103.7	32%	0.321	50%	0.495	S	S	.	.			trans	-116.3	139	178.8	-163.8	-17.2	0	0	0	109.8	S10 A48 C52	S10-N50 PolarHBondContact OG-ND2 2.83Å; A48-N50 VanDerWaalsContact C-N 3.35Å; N50-C52 VanDerWaalsContact C-N 3.32Å; N50-C52 PolarHBondContact OD1-N 2.92Å
51	R	88.3	Confident	87.7	Confident	215 Å²	215	103.6 Å²	103.6	81%	0.811	50%	0.499	S	S	*	.	S	Bend	trans	-81.6	-15.1	177.5	-69.5	151.2	-75.2	-138	-5	112.3
52	C	90	Very high	86.2	Confident	32 Å²	32	100.6 Å²	100.6	22%	0.216	49%	0.488	C	S	.	.			trans	-80.8	117.9	178	-165.3	0	0	0	0	110.7	V12 N50 V55	V12-C52 WeakPolarHBondContact CG1-O 3.27Å; V12-C52 HydrophobicContact CG2-CB 4.05Å; V12-C52 WeakPolarHBondContact CG2-O 3.46Å; N50-C52 VanDerWaalsContact C-N 3.32Å; N50-C52 PolarHBondContact OD1-N 2.92Å; C52-V55 WeakPolarHBondContact SG-CG2 3.3Å
53	I	90.5	Very high	84.8	Confident	85 Å²	85	103.9 Å²	103.9	44%	0.436	50%	0.503	S	S	.	.			trans	-97.9	-29.1	-175.6	-43.2	-177.1	0	0	0	111.7	V12 P26 L35	V12-I53 WeakPolarHBondContact CG1-O 3.41Å; P26-I53 HydrophobicContact CB-CD1 4.21Å; P26-I53 HydrophobicContact CB-CG2 3.62Å; P26-I53 HydrophobicContact CG-CG2 3.47Å; P26-I53 VanDerWaalsContact CG-CG2 3.47Å; L35-I53 HydrophobicContact CD1-CD1 3.84Å; L35-I53 HydrophobicContact CD1-CG1 4.48Å; L35-I53 HydrophobicContact CD2-CD1 4.08Å; L35-I53 HydrophobicContact CD2-CG1 3.85Å
54	Y	90	Very high	83.5	Confident	175 Å²	175	99.4 Å²	99.4	69%	0.686	48%	0.479	S	S	*	.			trans	-151.1	134.3	-176.6	176.2	-108.1	0	0	0	109.9	N56	Y54-N56 HydrophobicContact CE1-CB 3.79Å
55	V	89.2	Confident	82.3	Confident	38 Å²	38	101.2 Å²	101.2	23%	0.23	49%	0.49	C	S	.	.			trans	-130.4	123.2	172.5	-178.6	0	0	0	0	107.3	L9 V12 C52 R57	L9-V55 HydrophobicContact CB-CG1 4.09Å; L9-V55 HydrophobicContact CB-CG2 4.21Å; L9-V55 HydrophobicContact CD1-CG1 4.09Å; L9-V55 HydrophobicContact CD2-CG2 4.32Å; V12-V55 HydrophobicContact CG2-CG2 3.76Å; C52-V55 WeakPolarHBondContact SG-CG2 3.3Å; V55-R57 HydrophobicContact CG1-CG 4.07Å
56	N	86	Confident	81.2	Confident	105 Å²	105	98.7 Å²	98.7	56%	0.561	49%	0.493	S	S	*	.			trans	-104.2	116.8	168.5	-171.5	19.4	0	0	0	109.3	Y54	Y54-N56 HydrophobicContact CE1-CB 3.79Å
57	R	82	Confident	80.2	Confident	114 Å²	114	103 Å²	103	43%	0.43	51%	0.513	S	S	.	.			trans	-96.5	93.1	174.6	-65.8	-179.9	177.8	-178.7	-1.9	108.7	L9 V55 H59 E60	L9-R57 PolarHBondContact O-NH2 3.36Å; V55-R57 HydrophobicContact CG1-CG 4.07Å; R57-H59 VanDerWaalsContact C-N 3.34Å; R57-E60 HydrophobicContact CB-CB 4.13Å; R57-E60 VanDerWaalsContact CD-OE1 3.23Å; R57-E60 WeakPolarHBondContact CD-OE1 2.67Å; R57-E60 IonicContact CZ-OE1 2.85Å; R57-E60 IonicContact NE-OE1 2.68Å; R57-E60 IonicContact NH1-OE1 3.95Å; R57-E60 PolarHBondContact NH1-OE1 2.84Å
58	V	80.7	Confident	79.4	Confident	109 Å²	109	99.6 Å²	99.6	66%	0.661	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-40.5	-178.3	-176.6	0	0	0	0	111.4
59	H	74.1	Confident	78.8	Confident	180 Å²	180	102.8 Å²	102.8	83%	0.833	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	80.1	173.9	-60.9	-73.3	0	0	0	108.8	R57 K61	R57-H59 VanDerWaalsContact C-N 3.34Å; H59-K61 PolarHBondContact O-N 3.05Å
60	E	69.1	Low	78.4	Confident	119 Å²	119	98.5 Å²	98.5	56%	0.556	49%	0.485	S	S	*	.			trans	-80.6	116.6	169.6	-169.8	151.1	-132.1	0	0	108.3	R57 S62	R57-E60 HydrophobicContact CB-CB 4.13Å; R57-E60 VanDerWaalsContact CD-OE1 3.23Å; R57-E60 WeakPolarHBondContact CD-OE1 2.67Å; R57-E60 IonicContact CZ-OE1 2.85Å; R57-E60 IonicContact NE-OE1 2.68Å; R57-E60 IonicContact NH1-OE1 3.95Å; R57-E60 PolarHBondContact NH1-OE1 2.84Å; E60-S62 VanDerWaalsContact C-N 3.26Å; E60-S62 PolarHBondContact O-N 3.06Å
61	K	63.3	Low	78.1	Confident	180 Å²	180	100.3 Å²	100.3	78%	0.783	50%	0.495	S	S	*	.			trans	-66.7	99.3	156.1	-83.3	-177.2	176.9	177.6	0	105	H59 D63	H59-K61 PolarHBondContact O-N 3.05Å; K61-D63 PolarHBondContact O-N 3.11Å
62	S	63.6	Low	77.8	Confident	56 Å²	56	92.5 Å²	92.5	39%	0.392	47%	0.468	S	S	.	.			trans	-53.6	125.9	165	42.6	0	0	0	0	106.6	E60 D64	E60-S62 VanDerWaalsContact C-N 3.26Å; E60-S62 PolarHBondContact O-N 3.06Å; S62-D64 WeakPolarHBondContact CB-OD1 3.38Å; S62-D64 PolarHBondContact O-N 2.67Å; S62-D64 PolarHBondContact OG-OD1 3.07Å
63	D	68.2	Low	77.5	Confident	102 Å²	102	91.6 Å²	91.6	55%	0.545	46%	0.462	S	S	.	.			trans	-71.7	85.9	162.8	-170.7	5	0	0	0	105.3	K61 L65 S66	K61-D63 PolarHBondContact O-N 3.11Å; D63-L65 PolarHBondContact O-N 3.08Å; D63-L65 WeakPolarHBondContact OD1-CB 3.48Å; D63-S66 WeakPolarHBondContact O-CB 3.38Å; D63-S66 PolarHBondContact O-N 2.89Å; D63-S66 PolarHBondContact O-OG 3.22Å
64	D	67.5	Low	77.1	Confident	50 Å²	50	94.1 Å²	94.1	27%	0.267	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-54	-29.3	-175.6	-69.1	-23.7	0	0	0	110.4	S62 Q67 I68 L113	S62-D64 WeakPolarHBondContact CB-OD1 3.38Å; S62-D64 PolarHBondContact O-N 2.67Å; S62-D64 PolarHBondContact OG-OD1 3.07Å; D64-Q67 PolarHBondContact O-N 2.91Å; D64-I68 WeakPolarHBondContact O-CG1 3.42Å; D64-L113 HydrophobicContact CB-CD1 4.29Å
65	L	70.5	Confident	77	Confident	71 Å²	71	88.7 Å²	88.7	37%	0.372	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-58	-48.9	172.8	-62.4	172.2	0	0	0	110.8	D63 Q67 I68 L113 M121	D63-L65 PolarHBondContact O-N 3.08Å; D63-L65 WeakPolarHBondContact OD1-CB 3.48Å; L65-Q67 PolarHBondContact O-N 3Å; L65-I68 HydrophobicContact CD2-CD1 3.71Å; L65-I68 VanDerWaalsContact O-CB 3.3Å; L65-I68 WeakPolarHBondContact O-CB 3.19Å; L65-I68 WeakPolarHBondContact O-CG1 3.32Å; L65-I68 PolarHBondContact O-N 3.31Å; L65-L113 HydrophobicContact CD2-CD2 3.59Å; L65-L113 HydrophobicContact CG-CD2 4.34Å; L65-M121 WeakPolarHBondContact O-CE 3.41Å
66	S	73.1	Confident	76.9	Confident	83 Å²	83	92.6 Å²	92.6	58%	0.58	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-57.1	-18.8	-177	71.1	0	0	0	0	115.5	D63	D63-S66 WeakPolarHBondContact O-CB 3.38Å; D63-S66 PolarHBondContact O-N 2.89Å; D63-S66 PolarHBondContact O-OG 3.22Å
67	Q	72.3	Confident	77	Confident	148 Å²	148	93 Å²	93	69%	0.692	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-97.9	-3.3	179.1	-63.1	-173.2	-14.4	0	0	113.4	D64 L65 N69	D64-Q67 PolarHBondContact O-N 2.91Å; L65-Q67 PolarHBondContact O-N 3Å; Q67-N69 PolarHBondContact O-N 3.48Å
68	I	78.5	Confident	77.3	Confident	17 Å²	17	89.2 Å²	89.2	9%	0.087	48%	0.475	C	S	.	.			trans	-73	125.9	-179.8	-62.7	177.3	0	0	0	110	D64 L65 F97 L113 V115 M121	D64-I68 WeakPolarHBondContact O-CG1 3.42Å; L65-I68 HydrophobicContact CD2-CD1 3.71Å; L65-I68 VanDerWaalsContact O-CB 3.3Å; L65-I68 WeakPolarHBondContact O-CB 3.19Å; L65-I68 WeakPolarHBondContact O-CG1 3.32Å; L65-I68 PolarHBondContact O-N 3.31Å; I68-F97 HydrophobicContact CB-CZ 4.32Å; I68-F97 HydrophobicContact CD1-CE2 4.37Å; I68-F97 HydrophobicContact CD1-CZ 3.74Å; I68-F97 HydrophobicContact CG1-CE2 4.24Å; I68-F97 HydrophobicContact CG1-CZ 3.76Å; I68-F97 HydrophobicContact CG2-CE1 4.26Å; I68-F97 HydrophobicContact CG2-CZ 3.69Å; I68-L113 HydrophobicContact CD1-CB 4.09Å; I68-L113 HydrophobicContact CD1-CD1 4.32Å; I68-L113 HydrophobicContact CD1-CD2 4.03Å; I68-L113 HydrophobicContact CD1-CG 4.36Å; I68-V115 HydrophobicContact CD1-CG2 4.36Å; I68-V115 HydrophobicContact CG2-CG2 3.39Å; I68-M121 HydrophobicContact CB-CE 3.98Å
69	N	80.1	Confident	77.5	Confident	84 Å²	84	86.8 Å²	86.8	45%	0.449	46%	0.462	S	S	.	.			trans	-79.1	122.9	168.1	-174.3	0.5	0	0	0	109.7	Q67 D71 M72	Q67-N69 PolarHBondContact O-N 3.48Å; N69-D71 PolarHBondContact O-N 3.5Å; N69-D71 WeakPolarHBondContact OD1-CB 3.47Å; N69-D71 PolarHBondContact OD1-N 2.84Å; N69-D71 PolarHBondContact OD1-OD2 3.16Å; N69-M72 HydrophobicContact CB-CG 4.24Å; N69-M72 WeakPolarHBondContact O-CB 3.4Å; N69-M72 VanDerWaalsContact O-CG 3.23Å; N69-M72 WeakPolarHBondContact O-CG 3.46Å; N69-M72 PolarHBondContact O-N 2.86Å
70	T	80.5	Confident	78.2	Confident	45 Å²	45	83.9 Å²	83.9	28%	0.276	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-64.1	-24.1	176.1	48.3	0	0	0	0	113.2	M72 V73 M121	T70-M72 PolarHBondContact O-N 3.3Å; T70-M72 VanDerWaalsContact O-N 3.12Å; T70-V73 WeakPolarHBondContact O-CG2 3.23Å; T70-V73 PolarHBondContact O-N 3.04Å; T70-M121 HydrophobicContact CG2-CG 3.6Å; T70-M121 HydrophobicContact CG2-SD 4.34Å
71	D	82.1	Confident	78.9	Confident	99 Å²	99	79.3 Å²	79.3	53%	0.529	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-68.5	-11.3	-179.8	-59.2	-26.7	0	0	0	112.7	N69 V73 H74	N69-D71 PolarHBondContact O-N 3.5Å; N69-D71 WeakPolarHBondContact OD1-CB 3.47Å; N69-D71 PolarHBondContact OD1-N 2.84Å; N69-D71 PolarHBondContact OD1-OD2 3.16Å; D71-V73 PolarHBondContact O-N 2.87Å; D71-V73 VanDerWaalsContact O-N 3.13Å; D71-H74 PolarHBondContact O-N 3.47Å; D71-H74 VanDerWaalsContact O-N 3.08Å
72	M	83.5	Confident	79.9	Confident	50 Å²	50	76.5 Å²	76.5	25%	0.246	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-59.8	-21.6	175.6	-68.9	-177.6	71.9	0	0	113	N69 T70 H74 D75 L78 F97	N69-M72 HydrophobicContact CB-CG 4.24Å; N69-M72 WeakPolarHBondContact O-CB 3.4Å; N69-M72 VanDerWaalsContact O-CG 3.23Å; N69-M72 WeakPolarHBondContact O-CG 3.46Å; N69-M72 PolarHBondContact O-N 2.86Å; T70-M72 PolarHBondContact O-N 3.3Å; T70-M72 VanDerWaalsContact O-N 3.12Å; M72-H74 PolarHBondContact O-N 2.85Å; M72-H74 VanDerWaalsContact O-N 3.15Å; M72-D75 WeakPolarHBondContact O-CB 3.28Å; M72-D75 PolarHBondContact O-N 2.81Å; M72-D75 VanDerWaalsContact O-N 3.12Å; M72-L78 HydrophobicContact CB-CD1 3.97Å; M72-L78 HydrophobicContact CE-CD1 3.64Å; M72-F97 HydrophobicContact CE-CD1 3.81Å; M72-F97 HydrophobicContact CE-CD2 4.15Å; M72-F97 HydrophobicContact CE-CE1 3.97Å; M72-F97 HydrophobicContact CE-CE2 4.32Å; M72-F97 HydrophobicContact CE-CG 3.89Å; M72-F97 HydrophobicContact CE-CZ 4.23Å; M72-F97 HydrophobicContact SD-CE1 4.09Å; M72-F97 HydrophobicContact SD-CE2 4.47Å; M72-F97 HydrophobicContact SD-CZ 4.07Å
73	V	82.3	Confident	80.8	Confident	13 Å²	13	81.3 Å²	81.3	8%	0.079	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-60.3	-25.3	175.9	-178.3	0	0	0	0	112.3	T70 D71 V95 V115	T70-V73 WeakPolarHBondContact O-CG2 3.23Å; T70-V73 PolarHBondContact O-N 3.04Å; D71-V73 PolarHBondContact O-N 2.87Å; D71-V73 VanDerWaalsContact O-N 3.13Å; V73-V95 HydrophobicContact CG1-CG2 4.41Å; V73-V115 HydrophobicContact CG2-CB 4.23Å; V73-V115 HydrophobicContact CG2-CG1 3.55Å
74	H	83.5	Confident	81.4	Confident	139 Å²	139	81.7 Å²	81.7	64%	0.644	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-91.2	-5.1	-179	-61.4	-55.6	0	0	0	114.1	D71 M72 P76	D71-H74 PolarHBondContact O-N 3.47Å; D71-H74 VanDerWaalsContact O-N 3.08Å; M72-H74 PolarHBondContact O-N 2.85Å; M72-H74 VanDerWaalsContact O-N 3.15Å; H74-P76 VanDerWaalsContact O-CD 3.27Å; H74-P76 WeakPolarHBondContact O-CD 3.39Å
75	D	86.5	Confident	82	Confident	60 Å²	60	82.4 Å²	82.4	32%	0.321	44%	0.438	S	S	.	.			trans	-73.6	114.1	178.2	-171.4	-21.1	0	0	0	110.3	M72 T77 L78	M72-D75 WeakPolarHBondContact O-CB 3.28Å; M72-D75 PolarHBondContact O-N 2.81Å; M72-D75 VanDerWaalsContact O-N 3.12Å; D75-T77 VanDerWaalsContact CG-OG1 3.25Å; D75-T77 PolarHBondContact O-N 3.32Å; D75-T77 WeakPolarHBondContact OD1-CB 3.33Å; D75-T77 PolarHBondContact OD1-N 2.67Å; D75-T77 PolarHBondContact OD1-OG1 3Å; D75-T77 PolarHBondContact OD2-OG1 3.49Å; D75-L78 HydrophobicContact CB-CD1 3.9Å; D75-L78 HydrophobicContact CB-CG 3.97Å; D75-L78 PolarHBondContact O-N 3.49Å
76	P	87.4	Confident	82.5	Confident	120 Å²	120	79.2 Å²	79.2	78%	0.779	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.9	-179.1	30.5	-35.7	0	0	0	113.3	H74	H74-P76 VanDerWaalsContact O-CD 3.27Å; H74-P76 WeakPolarHBondContact O-CD 3.39Å
77	T	88.6	Confident	82.9	Confident	115 Å²	115	79.7 Å²	79.7	71%	0.706	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-13.9	179.6	71.1	0	0	0	0	113	D75	D75-T77 VanDerWaalsContact CG-OG1 3.25Å; D75-T77 PolarHBondContact O-N 3.32Å; D75-T77 WeakPolarHBondContact OD1-CB 3.33Å; D75-T77 PolarHBondContact OD1-N 2.67Å; D75-T77 PolarHBondContact OD1-OG1 3Å; D75-T77 PolarHBondContact OD2-OG1 3.49Å
78	L	87.1	Confident	83.5	Confident	33 Å²	33	79.9 Å²	79.9	17%	0.173	42%	0.424	C	S	.	.	S	Bend	trans	-87.8	142.6	179.8	-64.3	178.4	0	0	0	111.9	M72 D75 V95	M72-L78 HydrophobicContact CB-CD1 3.97Å; M72-L78 HydrophobicContact CE-CD1 3.64Å; D75-L78 HydrophobicContact CB-CD1 3.9Å; D75-L78 HydrophobicContact CB-CG 3.97Å; D75-L78 PolarHBondContact O-N 3.49Å; L78-V95 HydrophobicContact CB-CG1 3.36Å; L78-V95 HydrophobicContact CD1-CG1 3.68Å; L78-V95 HydrophobicContact CG-CG1 4.14Å
79	P	86.6	Confident	83.8	Confident	59 Å²	59	81.3 Å²	81.3	38%	0.383	44%	0.435	S	S	.	.			trans	-74.3	137.9	-179	31.6	-35.4	0	0	0	111.6	V95 F96	P79-V95 WeakPolarHBondContact O-CA 3.39Å; P79-F96 HydrophobicContact CB-CD1 4.45Å; P79-F96 HydrophobicContact CB-CE1 3.72Å; P79-F96 HydrophobicContact CB-CE2 3.9Å; P79-F96 HydrophobicContact CB-CZ 3.41Å; P79-F96 VanDerWaalsContact CB-CZ 3.41Å; P79-F96 HydrophobicContact CG-CD1 4.27Å; P79-F96 HydrophobicContact CG-CD2 3.79Å; P79-F96 HydrophobicContact CG-CE1 3.9Å; P79-F96 HydrophobicContact CG-CE2 3.37Å; P79-F96 HydrophobicContact CG-CG 4.23Å; P79-F96 HydrophobicContact CG-CZ 3.45Å; P79-F96 VanDerWaalsContact CG-CZ 3.45Å; P79-F96 WeakPolarHBondContact CG-O 3.31Å; P79-F96 PolarHBondContact O-N 3.01Å
80	K	86.9	Confident	83.8	Confident	118 Å²	118	84.6 Å²	84.6	51%	0.513	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	146.6	179.6	-62.4	-175.7	177.2	-166.5	0	110.8	A94 V95	K80-A94 CarbonylContact C-O 3.54Å; K80-A94 WeakPolarHBondContact CA-O 3.49Å; K80-V95 HydrophobicContact CG-CG2 4.11Å
81	T	83.9	Confident	83.9	Confident	24 Å²	24	87.8 Å²	87.8	15%	0.147	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.6	172.3	-176.1	0	0	0	0	110.6	E83 A94 F96	T81-E83 PolarHBondContact OG1-N 3.38Å; T81-E83 VanDerWaalsContact OG1-N 3.15Å; T81-A94 HydrophobicContact CG2-CB 4.35Å; T81-A94 PolarHBondContact N-O 3Å; T81-A94 PolarHBondContact O-N 2.91Å; T81-F96 HydrophobicContact CG2-CD1 4.01Å; T81-F96 HydrophobicContact CG2-CE1 4.44Å
82	E	85.3	Confident	83.8	Confident	121 Å²	121	90.7 Å²	90.7	57%	0.565	46%	0.461	S	S	*	.	S	Bend	trans	-107.9	-3	170.7	-68.3	-172.3	-171.1	0	0	113	H84 R92	E82-H84 VanDerWaalsContact C-N 3.28Å; E82-H84 PolarHBondContact O-N 3.44Å; E82-R92 VanDerWaalsContact CA-O 3.31Å; E82-R92 WeakPolarHBondContact CA-O 3.23Å; E82-R92 HydrophobicContact CB-CB 4.09Å; E82-R92 HydrophobicContact CG-CB 4.32Å
83	E	82.2	Confident	83.8	Confident	157 Å²	157	93 Å²	93	73%	0.734	47%	0.471	S	S	*	.	S	Bend	trans	-75.2	-18.5	-172.1	-63.7	-179	177.1	0	0	113	T81 P85	T81-E83 PolarHBondContact OG1-N 3.38Å; T81-E83 VanDerWaalsContact OG1-N 3.15Å; E83-P85 WeakPolarHBondContact O-CD 3.41Å
84	H	80	Confident	83.9	Confident	109 Å²	109	92.5 Å²	92.5	51%	0.505	47%	0.468	S	S	.	.	S	Bend	trans	-121.9	83.4	-174.3	-62.7	-50.2	0	0	0	111.1	E82	E82-H84 VanDerWaalsContact C-N 3.28Å; E82-H84 PolarHBondContact O-N 3.44Å
85	P	80.9	Confident	83.9	Confident	66 Å²	66	86 Å²	86	43%	0.429	44%	0.438	S	S	.	.			trans	-65.5	141.1	177.7	26.8	-33.3	0	0	0	111.1	E83 Q91 R92	E83-P85 WeakPolarHBondContact O-CD 3.41Å; P85-Q91 CarbonylContact C-O 3.55Å; P85-Q91 VanDerWaalsContact CA-O 3.28Å; P85-Q91 WeakPolarHBondContact CA-O 3.27Å; P85-R92 HydrophobicContact CB-CG 4.39Å
86	C	81.4	Confident	83.8	Confident	4 Å²	4	86.6 Å²	86.6	3%	0.027	44%	0.438	C	S	.	.			trans	-63.7	133.6	178.7	170	0	0	0	0	111	Q88 F90 Q91 S116 C122	C86-Q88 PolarHBondContact O-N 3.41Å; C86-Q88 VanDerWaalsContact O-N 3.13Å; C86-Q88 PolarHBondContact SG-N 2.9Å; C86-Q88 VanDerWaalsContact SG-N 3.36Å; C86-F90 WeakPolarHBondContact O-CA 3.42Å; C86-F90 PolarHBondContact O-N 3.38Å; C86-Q91 PolarHBondContact N-O 2.76Å; C86-S116 VanDerWaalsContact CB-OG 3.24Å; C86-S116 WeakPolarHBondContact CB-OG 3.21Å; C86-C122 HydrophobicContact CB-CB 4.16Å; C86-C122 WeakPolarHBondContact CB-SG 3.24Å; C86-C122 WeakPolarHBondContact SG-CB 3.47Å; C86-C122 CovalentContact SG-SG 2.07Å; C86-C122 PolarHBondContact SG-SG 3.18Å
87	P	82	Confident	83.5	Confident	92 Å²	92	82.3 Å²	82.3	60%	0.597	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.4	-179.3	25.9	-35.9	0	0	0	114.5
88	Q	83.7	Confident	83	Confident	153 Å²	153	84.4 Å²	84.4	72%	0.715	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-47.9	-179.7	-65.8	-69	-56.3	0	0	112.9	C86	C86-Q88 PolarHBondContact O-N 3.41Å; C86-Q88 VanDerWaalsContact O-N 3.13Å; C86-Q88 PolarHBondContact SG-N 2.9Å; C86-Q88 VanDerWaalsContact SG-N 3.36Å
89	C	85.1	Confident	82.3	Confident	47 Å²	47	85.4 Å²	85.4	32%	0.318	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-6.3	-172.9	69.1	0	0	0	0	114.4	Q91 C118	C89-Q91 PolarHBondContact O-N 2.97Å; C89-C118 VanDerWaalsContact SG-SG 3.69Å
90	F	80.9	Confident	81.4	Confident	152 Å²	152	91.6 Å²	91.6	67%	0.667	44%	0.442	S	S	*	.			trans	58.8	13.7	-179.4	-56.5	-81.1	0	0	0	115.8	C86	C86-F90 WeakPolarHBondContact O-CA 3.42Å; C86-F90 PolarHBondContact O-N 3.38Å
91	Q	81.6	Confident	80.3	Confident	112 Å²	112	87.9 Å²	87.9	52%	0.523	43%	0.432	S	S	.	.			trans	-63.3	135.8	167.3	-70.3	-65	-18.5	0	0	109.4	P85 C86 C89	P85-Q91 CarbonylContact C-O 3.55Å; P85-Q91 VanDerWaalsContact CA-O 3.28Å; P85-Q91 WeakPolarHBondContact CA-O 3.27Å; C86-Q91 PolarHBondContact N-O 2.76Å; C89-Q91 PolarHBondContact O-N 2.97Å
92	R	81.3	Confident	79.2	Confident	161 Å²	161	93.7 Å²	93.7	61%	0.608	47%	0.467	S	S	*	.			trans	-83.8	-32.1	-174.4	-67.9	-175.9	-176.1	178.8	-0.1	112.8	E82 P85 A94	E82-R92 VanDerWaalsContact CA-O 3.31Å; E82-R92 WeakPolarHBondContact CA-O 3.23Å; E82-R92 HydrophobicContact CB-CB 4.09Å; E82-R92 HydrophobicContact CG-CB 4.32Å; P85-R92 HydrophobicContact CB-CG 4.39Å; R92-A94 PolarHBondContact O-N 2.68Å
93	E	82.8	Confident	77.8	Confident	99 Å²	99	97.3 Å²	97.3	46%	0.463	48%	0.481	S	S	.	.			trans	-68	116.8	-179.1	-72.1	-168.4	161.5	0	0	111.5
94	A	83.2	Confident	76.3	Confident	2 Å²	2	92.4 Å²	92.4	2%	0.017	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	144.4	173.5	0	0	0	0	0	110.9	K80 T81 R92 T114 V115	K80-A94 CarbonylContact C-O 3.54Å; K80-A94 WeakPolarHBondContact CA-O 3.49Å; T81-A94 HydrophobicContact CG2-CB 4.35Å; T81-A94 PolarHBondContact N-O 3Å; T81-A94 PolarHBondContact O-N 2.91Å; R92-A94 PolarHBondContact O-N 2.68Å; A94-T114 HydrophobicContact CB-CG2 3.36Å; A94-V115 CarbonylContact C-O 3.56Å; A94-V115 WeakPolarHBondContact CA-O 3.42Å
95	V	85.5	Confident	74.8	Confident	2 Å²	2	95.6 Å²	95.6	1%	0.012	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.4	175	178.8	0	0	0	0	108.4	V73 L78 P79 K80 T114 V115	V73-V95 HydrophobicContact CG1-CG2 4.41Å; L78-V95 HydrophobicContact CB-CG1 3.36Å; L78-V95 HydrophobicContact CD1-CG1 3.68Å; L78-V95 HydrophobicContact CG-CG1 4.14Å; P79-V95 WeakPolarHBondContact O-CA 3.39Å; K80-V95 HydrophobicContact CG-CG2 4.11Å; V95-T114 CarbonylContact O-C 3.59Å; V95-T114 VanDerWaalsContact O-CA 3.3Å; V95-T114 WeakPolarHBondContact O-CA 3.35Å; V95-V115 PolarHBondContact N-O 2.93Å; V95-V115 PolarHBondContact O-N 3.34Å
96	F	82.7	Confident	72.9	Confident	72 Å²	72	98.1 Å²	98.1	32%	0.316	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.9	176.1	62.7	-90.3	0	0	0	112.4	P79 T81 L113	P79-F96 HydrophobicContact CB-CD1 4.45Å; P79-F96 HydrophobicContact CB-CE1 3.72Å; P79-F96 HydrophobicContact CB-CE2 3.9Å; P79-F96 HydrophobicContact CB-CZ 3.41Å; P79-F96 VanDerWaalsContact CB-CZ 3.41Å; P79-F96 HydrophobicContact CG-CD1 4.27Å; P79-F96 HydrophobicContact CG-CD2 3.79Å; P79-F96 HydrophobicContact CG-CE1 3.9Å; P79-F96 HydrophobicContact CG-CE2 3.37Å; P79-F96 HydrophobicContact CG-CG 4.23Å; P79-F96 HydrophobicContact CG-CZ 3.45Å; P79-F96 VanDerWaalsContact CG-CZ 3.45Å; P79-F96 WeakPolarHBondContact CG-O 3.31Å; P79-F96 PolarHBondContact O-N 3.01Å; T81-F96 HydrophobicContact CG2-CD1 4.01Å; T81-F96 HydrophobicContact CG2-CE1 4.44Å; F96-L113 CarbonylContact C-O 3.52Å; F96-L113 WeakPolarHBondContact CA-O 3.5Å
97	F	81.8	Confident	71.1	Confident	30 Å²	30	106.4 Å²	106.4	13%	0.132	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	163.9	177.1	57.3	-87.6	0	0	0	111.4	I68 M72 L113 V115	I68-F97 HydrophobicContact CB-CZ 4.32Å; I68-F97 HydrophobicContact CD1-CE2 4.37Å; I68-F97 HydrophobicContact CD1-CZ 3.74Å; I68-F97 HydrophobicContact CG1-CE2 4.24Å; I68-F97 HydrophobicContact CG1-CZ 3.76Å; I68-F97 HydrophobicContact CG2-CE1 4.26Å; I68-F97 HydrophobicContact CG2-CZ 3.69Å; M72-F97 HydrophobicContact CE-CD1 3.81Å; M72-F97 HydrophobicContact CE-CD2 4.15Å; M72-F97 HydrophobicContact CE-CE1 3.97Å; M72-F97 HydrophobicContact CE-CE2 4.32Å; M72-F97 HydrophobicContact CE-CG 3.89Å; M72-F97 HydrophobicContact CE-CZ 4.23Å; M72-F97 HydrophobicContact SD-CE1 4.09Å; M72-F97 HydrophobicContact SD-CE2 4.47Å; M72-F97 HydrophobicContact SD-CZ 4.07Å; F97-L113 HydrophobicContact CD2-CB 4.3Å; F97-L113 HydrophobicContact CE1-CB 4.4Å; F97-L113 HydrophobicContact CE2-CB 3.87Å; F97-L113 HydrophobicContact CE2-CD1 3.93Å; F97-L113 HydrophobicContact CZ-CB 3.93Å; F97-L113 PolarHBondContact N-O 2.74Å; F97-L113 PolarHBondContact O-N 2.83Å; F97-V115 HydrophobicContact CE1-CG2 3.62Å; F97-V115 HydrophobicContact CZ-CG2 4.09Å
98	Q	77.5	Confident	68.9	Low	159 Å²	159	106.2 Å²	106.2	74%	0.743	53%	0.528	S	S	*	.			trans	-93.8	140.3	171.5	-67.9	-178.2	-18.1	0	0	109.4	Q100	Q98-Q100 PolarHBondContact O-N 3.47Å
99	S	72.2	Confident	66.7	Low	54 Å²	54	108.6 Å²	108.6	38%	0.378	54%	0.536	S	S	.	.			trans	-62.9	134.1	174.7	60.6	0	0	0	0	109.9	S101	S99-S101 PolarHBondContact O-N 3.02Å
100	Q	67.7	Low	64.7	Low	189 Å²	189	110.6 Å²	110.6	88%	0.883	55%	0.551	S	S	*	*			trans	-87	12.3	179.7	-60.8	-172.4	22.2	0	0	112.7	Q98 T102	Q98-Q100 PolarHBondContact O-N 3.47Å; Q100-T102 PolarHBondContact O-N 2.77Å
101	S	64.2	Low	63.4	Low	41 Å²	41	108.4 Å²	108.4	29%	0.287	55%	0.552	S	S	.	*			trans	-71.9	106	-173.7	41.6	0	0	0	0	111	S99 K103 A104	S99-S101 PolarHBondContact O-N 3.02Å; S101-K103 PolarHBondContact O-N 2.97Å; S101-K103 VanDerWaalsContact O-N 3.11Å; S101-A104 WeakPolarHBondContact O-CB 3.48Å; S101-A104 PolarHBondContact O-N 2.82Å
102	T	61.5	Low	62.4	Low	145 Å²	145	106.2 Å²	106.2	89%	0.89	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.4	175	55.1	0	0	0	0	113.7	Q100 A104	Q100-T102 PolarHBondContact O-N 2.77Å; T102-A104 VanDerWaalsContact C-N 3.27Å; T102-A104 PolarHBondContact O-N 3.03Å
103	K	56.6	Low	61.7	Low	197 Å²	197	99.7 Å²	99.7	86%	0.857	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.7	174	-78	-174.8	176.1	-179.3	0	114	S101 E105	S101-K103 PolarHBondContact O-N 2.97Å; S101-K103 VanDerWaalsContact O-N 3.11Å; K103-E105 PolarHBondContact O-N 3.43Å
104	A	50.4	Low	61.1	Low	55 Å²	55	97.1 Å²	97.1	46%	0.455	52%	0.517	S	S	.	.			trans	-73.4	82.8	172.3	0	0	0	0	0	109	S101 T102 V106	S101-A104 WeakPolarHBondContact O-CB 3.48Å; S101-A104 PolarHBondContact O-N 2.82Å; T102-A104 VanDerWaalsContact C-N 3.27Å; T102-A104 PolarHBondContact O-N 3.03Å; A104-V106 VanDerWaalsContact C-N 3.35Å; A104-V106 PolarHBondContact O-N 3.05Å
105	E	47	Very low	60.5	Low	176 Å²	176	97 Å²	97	82%	0.822	52%	0.517	S	S	*	.			trans	-54.6	102.7	165	-167.2	170.6	168.9	0	0	108	K103 R107	K103-E105 PolarHBondContact O-N 3.43Å; E105-R107 PolarHBondContact O-N 2.89Å; E105-R107 VanDerWaalsContact O-N 3.16Å
106	V	41.9	Very low	59.8	Low	118 Å²	118	97.2 Å²	97.2	72%	0.715	52%	0.518	S	S	*	.			trans	44.6	57.7	161.9	-160.1	0	0	0	0	113.7	A104 S108	A104-V106 VanDerWaalsContact C-N 3.35Å; A104-V106 PolarHBondContact O-N 3.05Å; V106-S108 WeakPolarHBondContact CG1-OG 3.31Å; V106-S108 PolarHBondContact O-N 3.49Å
107	R	43.3	Very low	59	Low	178 Å²	178	96 Å²	96	67%	0.672	52%	0.518	S	S	*	.			trans	-89.2	72.9	154.1	-81.7	-175.4	165.8	-163.8	-8.7	109	E105 F109	E105-R107 PolarHBondContact O-N 2.89Å; E105-R107 VanDerWaalsContact O-N 3.16Å; R107-F109 PolarHBondContact O-N 2.89Å; R107-F109 VanDerWaalsContact O-N 3.08Å
108	S	35.4	Very low	58.2	Low	89 Å²	89	96 Å²	96	62%	0.622	52%	0.522	S	S	*	.			trans	-49	113.3	158.6	-49.8	0	0	0	0	107.7	V106	V106-S108 WeakPolarHBondContact CG1-OG 3.31Å; V106-S108 PolarHBondContact O-N 3.49Å
109	F	37.7	Very low	57.3	Low	202 Å²	202	96.2 Å²	96.2	89%	0.886	52%	0.522	S	S	*	.	S	Bend	trans	65	83.4	171.1	-65	-96.1	0	0	0	116.9	R107	R107-F109 PolarHBondContact O-N 2.89Å; R107-F109 VanDerWaalsContact O-N 3.08Å
110	S	44	Very low	56.5	Low	90 Å²	90	103.4 Å²	103.4	63%	0.629	54%	0.541	S	S	*	.			trans	167.3	158.4	142.4	42.5	0	0	0	0	113
111	P	52.7	Low	55.6	Low	106 Å²	106	98.6 Å²	98.6	69%	0.688	52%	0.52	S	S	*	.	P	Polyproline II helix		-102.7	160.5	-53.9	33.5	-19.7	0	0	0	110.3	L113	P111-L113 PolarHBondContact O-N 2.8Å
112	S	61.8	Low	54.9	Low	65 Å²	65	99 Å²	99	46%	0.455	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-55.8	121.9	167	-39.2	0	0	0	0	108.7
113	L	66.8	Low	54.5	Low	24 Å²	24	96.7 Å²	96.7	13%	0.126	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	131.4	173.5	-71	154	0	0	0	107.2	D64 L65 I68 F96 F97 P111	D64-L113 HydrophobicContact CB-CD1 4.29Å; L65-L113 HydrophobicContact CD2-CD2 3.59Å; L65-L113 HydrophobicContact CG-CD2 4.34Å; I68-L113 HydrophobicContact CD1-CB 4.09Å; I68-L113 HydrophobicContact CD1-CD1 4.32Å; I68-L113 HydrophobicContact CD1-CD2 4.03Å; I68-L113 HydrophobicContact CD1-CG 4.36Å; F96-L113 CarbonylContact C-O 3.52Å; F96-L113 WeakPolarHBondContact CA-O 3.5Å; F97-L113 HydrophobicContact CD2-CB 4.3Å; F97-L113 HydrophobicContact CE1-CB 4.4Å; F97-L113 HydrophobicContact CE2-CB 3.87Å; F97-L113 HydrophobicContact CE2-CD1 3.93Å; F97-L113 HydrophobicContact CZ-CB 3.93Å; F97-L113 PolarHBondContact N-O 2.74Å; F97-L113 PolarHBondContact O-N 2.83Å; P111-L113 PolarHBondContact O-N 2.8Å
114	T	68.9	Low	54.4	Low	45 Å²	45	91.4 Å²	91.4	28%	0.276	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.8	-173.4	-60.5	0	0	0	0	109.5	A94 V95	A94-T114 HydrophobicContact CB-CG2 3.36Å; V95-T114 CarbonylContact O-C 3.59Å; V95-T114 VanDerWaalsContact O-CA 3.3Å; V95-T114 WeakPolarHBondContact O-CA 3.35Å
115	V	71.4	Confident	54.7	Low	1 Å²	1	93.4 Å²	93.4	1%	0.006	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.6	176.5	-177	0	0	0	0	108.5	I68 V73 A94 V95 F97	I68-V115 HydrophobicContact CD1-CG2 4.36Å; I68-V115 HydrophobicContact CG2-CG2 3.39Å; V73-V115 HydrophobicContact CG2-CB 4.23Å; V73-V115 HydrophobicContact CG2-CG1 3.55Å; A94-V115 CarbonylContact C-O 3.56Å; A94-V115 WeakPolarHBondContact CA-O 3.42Å; V95-V115 PolarHBondContact N-O 2.93Å; V95-V115 PolarHBondContact O-N 3.34Å; F97-V115 HydrophobicContact CE1-CG2 3.62Å; F97-V115 HydrophobicContact CZ-CG2 4.09Å
116	S	71.1	Confident	55.1	Low	5 Å²	5	88.5 Å²	88.5	4%	0.035	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	162.6	175	74	0	0	0	0	111.5	C86 C118 C122	C86-S116 VanDerWaalsContact CB-OG 3.24Å; C86-S116 WeakPolarHBondContact CB-OG 3.21Å; S116-C118 PolarHBondContact O-N 3.45Å; S116-C118 VanDerWaalsContact O-O 3.13Å; S116-C122 PolarHBondContact OG-SG 3.07Å
117	S	65.7	Low	55.9	Low	46 Å²	46	86.7 Å²	86.7	32%	0.322	45%	0.451	S	S	.	.	S	Bend	trans	-63.3	-1.6	177.8	56.5	0	0	0	0	115.3	H119	S117-H119 PolarHBondContact O-N 2.85Å
118	C	65.3	Low	56.8	Low	32 Å²	32	80.6 Å²	80.6	22%	0.216	44%	0.437	C	S	.	.	S	Bend	trans	-61	121.8	163.9	-152.1	0	0	0	0	107.5	C89 S116 R120	C89-C118 VanDerWaalsContact SG-SG 3.69Å; S116-C118 PolarHBondContact O-N 3.45Å; S116-C118 VanDerWaalsContact O-O 3.13Å; C118-R120 CarbonylContact O-C 3.59Å; C118-R120 PolarHBondContact O-N 3.26Å; C118-R120 VanDerWaalsContact O-O 3.11Å
119	H	58.7	Low	58.3	Low	162 Å²	162	80 Å²	80	75%	0.75	42%	0.423	S	S	*	.	S	Bend	trans	-62.7	20.2	175.4	-91.4	58.8	0	0	0	113.9	S117	S117-H119 PolarHBondContact O-N 2.85Å
120	R	53.7	Low	59.9	Low	206 Å²	206	70.6 Å²	70.6	78%	0.777	39%	0.388	S	S	*	.	S	Bend	trans	-135.8	130.2	172.5	-74	-177.7	173.6	-114.9	-2.5	107.3	C118 C122	C118-R120 CarbonylContact O-C 3.59Å; C118-R120 PolarHBondContact O-N 3.26Å; C118-R120 VanDerWaalsContact O-O 3.11Å; R120-C122 PolarHBondContact O-N 3.4Å
121	M	50	Low	61.2	Low	87 Å²	87	69 Å²	69	43%	0.429	37%	0.368	S	S	.	.			trans	-56	111.4	-179.8	-62.9	147.9	82.6	0	0	109.2	L65 I68 T70	L65-M121 WeakPolarHBondContact O-CE 3.41Å; I68-M121 HydrophobicContact CB-CE 3.98Å; T70-M121 HydrophobicContact CG2-CG 3.6Å; T70-M121 HydrophobicContact CG2-SD 4.34Å
122	C	48.6	Very low	62	Low	49 Å²	49	65.6 Å²	65.6	33%	0.331	34%	0.338	S	S	.	.			trans	-83.4	0	152.5	-30.6	0	0	0	0	105.7	C86 S116 R120	C86-C122 HydrophobicContact CB-CB 4.16Å; C86-C122 WeakPolarHBondContact CB-SG 3.24Å; C86-C122 WeakPolarHBondContact SG-CB 3.47Å; C86-C122 CovalentContact SG-SG 2.07Å; C86-C122 PolarHBondContact SG-SG 3.18Å; S116-C122 PolarHBondContact OG-SG 3.07Å; R120-C122 PolarHBondContact O-N 3.4Å

Retrieved 122 of 122 residues in 55.1 ms (Link to these results)

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